CID 55262715

N,4-dimethyl-1,2,5-oxadiazol-3-amine

Structural Information

Molecular Formula
C4H7N3O
SMILES
CC1=NON=C1NC
InChI
InChI=1S/C4H7N3O/c1-3-4(5-2)7-8-6-3/h1-2H3,(H,5,7)
InChIKey
HNXYWYOVPHLAQF-UHFFFAOYSA-N
Compound name
N,4-dimethyl-1,2,5-oxadiazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

113.058914 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.06619 119.4
[M+Na]+ 136.04813 130.8
[M+NH4]+ 131.09274 127.2
[M+K]+ 152.02207 128.2
[M-H]- 112.05164 121.3
[M+Na-2H]- 134.03358 125.1
[M]+ 113.05837 121.3
[M]- 113.05946 121.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.